Information card for entry 4131122

Structure parameters

• Formula: C32 H46 Mn N5 O2
• Calculated formula: C32 H46 Mn N5 O2
• Title of publication: Tuning Electronic Structure To Control Manganese Nitride Activation.
• Authors of publication: Clarke, Ryan M.; Storr, Tim
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 47
• Pages of publication: 15299 - 15302
• a: 9.313 ± 0.004 Å
• b: 28.127 ± 0.011 Å
• c: 12.193 ± 0.005 Å
• α: 90°
• β: 102.813 ± 0.015°
• γ: 90°
• Cell volume: 3114 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.094
• Residual factor for significantly intense reflections: 0.0778
• Weighted residual factors for significantly intense reflections: 0.1681
• Weighted residual factors for all reflections included in the refinement: 0.1737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.267
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No